2-[(1-azanylisoquinolin-6-yl)amino]-N-tert-butylsulfonyl-2-(3-ethoxy-4-propan-2-yloxy-phenyl)ethanamide

Systemtic Name: 2-[(1-azanylisoquinolin-6-yl)amino]-N-tert-butylsulfonyl-2-(3-ethoxy-4-propan-2-yloxy-phenyl)ethanamide Openeye Name: 2-[(1-amino-6-isoquinolyl)amino]-N-tert-butylsulfonyl-2-(3-ethoxy-4-isopropoxy-phenyl)acetamide CAS Name: 2-[(1-amino-6-isoquinolinyl)amino]-N-tert-butylsulfonyl-2-(3-ethoxy-4-propan-2-yloxyphenyl)acetamide IUPAC Name: 2-[(1-aminoisoquinolin-6-yl)amino]-N-tert-butylsulfonyl-2-(3-ethoxy-4-propan-2-yloxyphenyl)acetamide Traditional Name: 2-[(1-amino-6-isoquinolyl)amino]-N-tert-butylsulfonyl-2-(3-ethoxy-4-isopropoxy-phenyl)acetamide Formula: C26H34N4O5S MolecularWeight: 514.63696

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(C(=O)NS(=O)(=O)C(C)(C)C)NC2=CC3=C(C=C2)C(=NC=C3)N)OC(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(C(=O)NS(=O)(=O)C(C)(C)C)NC2=CC3=C(C=C2)C(=NC=C3)N)OC(C)C

InChI

InChI=1S/C26H34N4O5S/c1-7-34-22-15-18(8-11-21(22)35-16(2)3)23(25(31)30-36(32,33)26(4,5)6)29-19-9-10-20-17(14-19)12-13-28-24(20)27/h8-16,23,29H,7H2,1-6H3,(H2,27,28)(H,30,31)